CAS No. 459133-68-7

 

Product Information

Chemical Formula: C12H12BrIN2O2
Molecular Weight:423.04
Synonyms:3-Iodo-5-Bromo-1H-Indazole-1-Carboxylic Acid Tert-Butyl Ester; Tert-Butyl 5-Bromo-3-Iodo-1H-Indazole-1-Carboxylate; 1-Boc-5-Bromo-3-Iodo-1H-Indazole; 1H-Indazole-1-Carboxylic Acid, 5-Bromo-3-Iodo-, 1,1-Dimethylethyl Ester; 5-Bromo-3-Iodo-1H-Indazole-1-Carboxylic Acid 1,1-Dimethylethyl Ester; 1-N-Boc-5-Bromo-3-Iodo-1H-Indazole
MDL No.:MFCD09056828
EINECS / EC No.:N/A
Pubchem CID:53439660
IUPAC Name:tert-butyl 5-bromo-3-iodoindazole-1-carboxylate
Standard InchI:InChI=1S/C12H12BrIN2O2/c1-12(2,3)18-11(17)16-9-5-4-7(13)6-8(9)10(14)15-16/h4-6H,1-3H3
InchI Key:RUXGCTDRNQBDSV-UHFFFAOYSA-N
SMILES:CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)Br)C(=N1)I
Appearance:-
Melting Point:187-190 °C
Boiling Point:444 °C
Density (Theoretical):1.91
Refractive Index:1.666

Safety Information

Signal Word: Danger
Hazard Statements:H301-H311-H331
Precautionary Statements:P261-P264-P270-P271-P280-P302 P352-P304 P340-P310-P330-P361-P403 P233-P405-P501
Flash Point:222 °C
Transportation Information:UN 2811 6.1/ PG III
GHS Pictograms:Skull and Crossbones - GHS06